Hydrochloric Acid

Hydrochloric Acid

SCHEMBL401315

CC(C)(C)c1ccc2c(c1)C(/[Zr+2](C1=CC=CC1)=C(\c1ccccc1)c1cccc(Cl)c1)c1cc(C(C)(C)C)ccc1-2.[Cl-].[Cl-]

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.31
PPARG P37231 1/20 0.31
NR1H4 Q96RI1 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL399137 0.97 KIF11 (0.31) PPARGNR1H4
Hydrochloric Acid SCHEMBL398223 0.94 MAPT (0.32)
Hydrochloric Acid SCHEMBL399755 0.93 GRM5 (0.32) GRM5PPARGNR1H4
Hydrochloric Acid SCHEMBL397055 0.92 PPARG (0.32) PPARGNR1H4
Hydrochloric Acid SCHEMBL452699 0.92 NPC1 (0.31)
Hydrochloric Acid SCHEMBL400914 0.90 PPARG (0.31) PPARGNR1H4
Hydrochloric Acid SCHEMBL5079539 0.90 MEN1 (0.33) NR1H4
Fluoride Ion SCHEMBL7641229 0.90 NPC1 (0.31)
Hydrochloric Acid SCHEMBL399225 0.89
Hydrochloric Acid SCHEMBL401424 0.88 GRM5 (0.30) GRM5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101684-B2 Thermoplastic resin composition for sealing solar cell, sheet for sealing solar cell and solar cell MITSUI CHEMICALS, INC. (JP) 2012-01-24 US disclosed
EP-2275457-A2 Propylene polymer, propylene-based polymer composition, and use of these Mitsui Chemicals, Inc. (JP) 2011-01-19 EP disclosed